3-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methoxyphenyl)methyl]propanamide
3-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methoxyphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | C241-1509 |
| Compound Name: | 3-{1-[(2,5-dimethylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methoxyphenyl)methyl]propanamide |
| Molecular Weight: | 477.58 |
| Molecular Formula: | C26 H27 N3 O4 S |
| Smiles: | Cc1ccc(C)c(CN2C(N(CCC(NCc3ccc(cc3)OC)=O)C(c3c2ccs3)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8388 |
| logD: | 4.8388 |
| logSw: | -4.5348 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.279 |
| InChI Key: | HWTGSYGWEOJAET-UHFFFAOYSA-N |